5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole

C15H20N2O — CID 84631519

IUPAC5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole
SMILESCOc1cc(C)c2c(c1)cc(C1CCCN1)n2C
InChIInChI=1S/C15H20N2O/c1-10-7-12(18-3)8-11-9-14(17(2)15(10)11)13-5-4-6-16-13/h7-9,13,16H,4-6H2,1-3H3
InChIKeyIOFAXVUPRJPGND-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.92
Rot. Bonds2

About 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole

5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole (PubChem CID 84631519) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole.

Molecular Properties

Compound Name5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole
PubChem CID84631519
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole
SMILESCOc1cc(C)c2c(c1)cc(C1CCCN1)n2C
InChIInChI=1S/C15H20N2O/c1-10-7-12(18-3)8-11-9-14(17(2)15(10)11)13-5-4-6-16-13/h7-9,13,16H,4-6H2,1-3H3
InChIKeyIOFAXVUPRJPGND-UHFFFAOYSA-N
XLogP2.92
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methoxy-1,5-dimethyl-2-pyrrolidin-2-ylindole
CID 84631498
7-methoxy-1,4-dimethyl-2-pyrrolidin-2-ylindole
CID 84631565
2-(2,5-dimethoxy-3-methylphenyl)pyrrolidine
CID 84686830
6-methoxy-8-methyl-3-pyrrolidin-2-yl-1H-quinolin-2-one
CID 84637119
6-chloro-5-methoxy-1-methyl-2-pyrrolidin-2-ylindole
CID 84639752
(2S)-2-(6-methoxynaphthalen-2-yl)pyrrolidine;hydrochloride
CID 171196228
2-[3-(4-methoxy-2-methylphenyl)imidazol-4-yl]piperidine
CID 114705681
5-methoxy-1,7-dimethylindole-2-carbaldehyde
CID 105455211
(2S)-2-(4-methoxy-2-methylphenyl)azepane
CID 26189003
(2R)-2-(4-methoxy-3,5-dimethylphenyl)pyrrolidine
CID 66518898
1,3-dimethyl-5-[(2R)-pyrrolidin-2-yl]pyrazole
CID 42575745
1,3,5,7-tetramethyl-2-pyrrolidin-2-ylindole
CID 84630526

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole?
The IUPAC name of 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole (CID 84631519) is 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole.
What is the SMILES notation for 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole?
The canonical SMILES for 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole is COc1cc(C)c2c(c1)cc(C1CCCN1)n2C.
What is the InChIKey of 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole?
The InChIKey is IOFAXVUPRJPGND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-7-12(18-3)8-11-9-14(17(2)15(10)11)13-5-4-6-16-13/h7-9,13,16H,4-6H2,1-3H3.
What are the key properties of 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole?
5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole has a molecular weight of 244.34 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole is sourced from PubChem (CID 84631519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).